Chem
J-GLOBAL ID：201307024419782962   Nikkaji number：J3.124.589C

Pentafluorobenzoic acid 4′-(dodecyloxy)-4-biphenylyl ester

ペンタフルオロ安息香酸4′-(ドデシルオキシ)-4-ビフェニリル
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C31H33F5O3
Molecular formula furigana： C31-H33-F5-O3
Molecular weight： 548.594
InChI： InChI=1S/C31H33F5O3/c1-2-3-4-5-6-7-8-9-10-11-20-38-23-16-12-21(13-17-23)22-14-18-24(19-15-22)39-31(37)25-26(32)28(34)30(36)29(35)27(25)33/h12-19H,2-11,20H2,1H3
InChI key： AOAFRZDHGYQCCH-UHFFFAOYSA-N
SMILES： CCCCCCCCCCCCOc1ccc(cc1)c1ccc(OC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1
Systematic name  (3)：
  • ペンタフルオロ安息香酸4′-(ドデシルオキシ)-4-ビフェニリル
  • 4'-(ドデシルオキシ)-[1,1'-ビフェニル]-4-イル 2,3,4,5,6-ペンタフルオロベンゾアート
  • 4'-(dodecyloxy)-[1,1'-biphenyl]-4-yl 2,3,4,5,6-pentafluorobenzoate
Other name (1)：
  • Pentafluorobenzoic acid 4′-(dodecyloxy)-4-biphenylyl ester
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